4-[5-(dimethylamino)pentyl]benzenesulfonic acid

Systemtic Name: 4-[5-(dimethylamino)pentyl]benzenesulfonic acid Openeye Name: 4-[5-(dimethylamino)pentyl]benzenesulfonic acid CAS Name: 4-[5-(dimethylamino)pentyl]benzenesulfonic acid IUPAC Name: 4-[5-(dimethylamino)pentyl]benzenesulfonic acid Traditional Name: 4-[5-(dimethylamino)pentyl]besylic acid Formula: C13H21NO3S MolecularWeight: 271.37574

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCCCC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CN(C)CCCCCC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C13H21NO3S/c1-14(2)11-5-3-4-6-12-7-9-13(10-8-12)18(15,16)17/h7-10H,3-6,11H2,1-2H3,(H,15,16,17)